SCHEMBL22493764

SCHEMBL22493764

Sc1ccnc2[nH]ccc12.[NaH]

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 6/20 0.57
AXL P30530 2/20 0.57
NUDT1 P36639 4/20 0.50
AURKB Q96GD4 3/20 0.50
JAK2 O60674 2/20 0.50
JAK3 P52333 2/20 0.50
IGF1R P08069 2/20 0.50
DYRK1B Q9Y463 2/20 0.50
IKBKB O14920 1/20 0.50
CHUK O15111 1/20 0.50
DAPK3 O43293 1/20 0.50
PRKD3 O94806 1/20 0.50
MAP4K4 O95819 1/20 0.50
PAK4 O96013 1/20 0.50
CSF1R P07333 1/20 0.50
RET P07949 1/20 0.50
FGFR1 P11362 1/20 0.50
PRKACA P17612 1/20 0.50
FLT1 P17948 1/20 0.50
LTK P29376 1/20 0.50

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30788412 0.98 PRKCI (0.59) PRKCIAXLNUDT1AURKBJAK2
SCHEMBL21062776 0.98 PRKCI (0.59) PRKCIAXLNUDT1AURKBJAK2
SCHEMBL29802760 0.96 PRKCI (0.57) PRKCIAXLNUDT1AURKBJAK2
SCHEMBL2240671 0.76 AURKB (0.71) PRKCIAXLNUDT1AURKBJAK2
SCHEMBL22799623 0.75 PRKCI (0.57) PRKCIAXLNUDT1AURKBJAK2
SCHEMBL91443 0.72 PRKCI (0.59) PRKCIAXLNUDT1AURKBJAK2
SCHEMBL99690 0.72 PRKCI (1.00) PRKCIAXLNUDT1AURKBJAK2
SCHEMBL1176829 0.72 PRKCI (0.59) PRKCIAXLNUDT1AURKBJAK2
SCHEMBL306661 0.72 PRKCI (0.59) PRKCIAXLNUDT1AURKBJAK2
SCHEMBL3339974 0.72 PRKCI (0.59) PRKCIAXLNUDT1AURKBJAK2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240124453-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2024-04-18 US disclosed
US-11884664-B2 Protein tyrosine phosphatase inhibitors ARRAY BIOPHARMA INC. (US) 2024-01-30 US disclosed
US-11634417-B2 Protein tyrosine phosphatase inhibitors ARRAY BIOPHARMA INC. (US) 2023-04-25 US disclosed
CN-114981268-A Pyrimidine-4 (3H) -ketone heterocyclic compound, preparation method and application thereof in medicine and pharmacology 北京诺诚健华医药科技有限公司 2022-08-30 CN disclosed
CN-113135910-A Pyrimidine-4 (3H) -ketone heterocyclic compound, preparation method and pharmaceutical application thereof 北京诺诚健华医药科技有限公司 2021-07-20 CN disclosed
US-20200317665-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2020-10-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11884664-B2 Protein tyrosine phosphatase inhibitors PPM1A, PPM1F, PPP5C PRKCI 217/4885AXL 793/4885NUDT1 1030/4885
US-20200317665-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS PPM1A, PPM1F, PPP5C PRKCI 217/4885AXL 793/4885NUDT1 1030/4885
US-20240124453-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS PPM1A, PPM1F, PPP5C PRKCI 217/4885AXL 793/4885NUDT1 1030/4885
US-11634417-B2 Protein tyrosine phosphatase inhibitors PPM1A, PPM1F, PPP5C PRKCI 217/4885AXL 793/4885NUDT1 1030/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.